SCHEMBL21920006

SCHEMBL21920006

CC(C)(C)OC(=O)N1CCN(c2cccc(B3OC(C)(C)C(C)(C)O3)c2)C(=O)C1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.42
NR1H2 P55055 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
GPR119 Q8TDV5 4/20 0.38
P2RX7 Q99572 1/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
ESR2 Q92731 1/20 0.36
MAPK1 P28482 1/20 0.36
ROCK1 Q13464 1/20 0.36
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
CRBN Q96SW2 1/20 0.35
ROCK2 O75116 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30088300 1.00 USP30 (0.42) USP30NR1H2ALDH1A1LMNAMAPT
SCHEMBL4390918 0.88 USP30 (0.46) USP30NR1H2ALDH1A1LMNAMAPT
SCHEMBL21805899 0.85 P2RX7 (0.42) ALDH1A1P2RX7ROCK1
SCHEMBL521045 0.84 GPR119 (0.51) USP30NR1H2ALDH1A1LMNAMAPT
SCHEMBL29384737 0.84 GPR119 (0.51) USP30NR1H2ALDH1A1LMNAMAPT
SCHEMBL26074164 0.81 PDK2 (0.48) USP30ALDH1A1LMNAMAPTGPR119
SCHEMBL30545632 0.81 PDK2 (0.48) USP30ALDH1A1LMNAMAPTGPR119
SCHEMBL19690382 0.81 USP30 (0.45) USP30NR1H2ALDH1A1LMNAMAPT
SCHEMBL24719496 0.80 LPL (0.36) ALDH1A1P2RX7PRMT5WDR77ROCK1
SCHEMBL22650344 0.80 NR1H2 (0.53) USP30NR1H2ALDH1A1LMNAMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117858874-A HPK1 degrading agents, compositions comprising the same, and methods of use thereof 百放开曼有限公司 2024-04-09 CN disclosed
WO-2023023942-A1 HPK1 INHIBITORS, COMPOSITIONS COMPRISING HPK1 INHIBITOR, AND METHODS OF USING THE SAME BIOFRONT LTD (CAYMAN) (KY) 2023-03-02 WO disclosed
WO-2023025092-A1 KINASE MODULATORS, COMPOSITIONS COMPRISING THE KINASE MODULATOR, AND METHODS OF USING THE SAME BIOFRONT LTD (CAYMAN) (KY) 2023-03-02 WO disclosed
CN-113015526-A Spirocyclic 2, 3-dihydro-7-azaindole compounds and uses thereof 豪夫迈·罗氏有限公司 2021-06-22 CN disclosed
WO-2020061377-A1 SPIROCYCLIC 2,3-DIHYDRO-7-AZAINDOLE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2020-03-26 WO disclosed